SCHEMBL2140712

SCHEMBL2140712

CS(=O)(=O)c1cccc(-c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.53
NR1H2 P55055 5/20 0.49
NR1H3 Q13133 4/20 0.48
SCD O00767 2/20 0.47
KCNH2 Q12809 1/20 0.47
LOXL2 Q9Y4K0 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
RAB9A P51151 1/20 0.46
PTGES2 Q9H7Z7 1/20 0.46
NPBWR1 P48145 1/20 0.46
HTR6 P50406 1/20 0.46
RXRA P19793 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17153735 0.96 PTGS2 (0.50) PTGS2NR1H2NR1H3SCDKCNH2
SCHEMBL6243674 0.93 KCNH2 (0.50) PTGS2NR1H2NR1H3KCNH2LOXL2
SCHEMBL8770634 0.85 PTGS2 (0.68) PTGS2
SCHEMBL26807210 0.85 PTGS2 (0.41) PTGS2NR1H2NR1H3SCDKCNH2
SCHEMBL145847 0.84 NR1H2 (0.45) NR1H2NR1H3KCNH2LOXL2RXRA
SCHEMBL5831675 0.84 PTGS2 (0.56) PTGS2NR1H2NR1H3SCD
SCHEMBL14320650 0.84 CA12 (0.51) NR1H2NR1H3KCNH2LOXL2
SCHEMBL8770103 0.84 KCNH2 (0.49) PTGS2NR1H2NR1H3KCNH2LOXL2
SCHEMBL30690007 0.84 ALOX5 (0.53) NR1H2NR1H3SCDKCNH2LOXL2
SCHEMBL17367960 0.84 ALOX5 (0.53) NR1H2NR1H3SCDKCNH2LOXL2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113631548-B Serotonin 5-HT2B inhibiting compounds 硕腾服务有限责任公司 2023-06-06 CN disclosed
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES GERO PTE. LTD. (SG) 2023-02-16 US disclosed
CN-108017479-B Method for producing aromatic compound 东曹株式会社 2022-07-29 CN disclosed
CN-113631548-A Serotonin 5-HT2B inhibiting compounds 硕腾服务有限责任公司 2021-11-09 CN disclosed
US-10246393-B2 Method for producing aromatic compound TOSOH CORPORATION (JP) 2019-04-02 US disclosed
US-20180118646-A1 METHOD FOR PRODUCING AROMATIC COMPOUND TOSOH CORPORATION (JP) 2018-05-03 US disclosed
US-20180118646-A1 METHOD FOR PRODUCING AROMATIC COMPOUND TOSOH CORPORATION (JP) 2018-05-03 US disclosed
EP-3315486-A1 METHOD FOR PRODUCING AROMATIC COMPOUND Tosoh Corporation (JP) 2018-05-02 EP disclosed
US-8476225-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-07-02 US disclosed
US-8242278-B2 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
EP-1703905-B1 INDOLE DERIVATIVES AND USE THEREOF AS KINASE INHIBITORS IN PARTICULAR IKK2 INHIBITORS SMITHKLINE BEECHAM CORP (US) 2008-11-12 EP disclosed
US-20080269200-A1 Indole Derivatives and Use Thereof as Kinase Inhibitors in Particular Ikk2 Inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-10-30 US disclosed
US-20080269200-A1 Indole Derivatives and Use Thereof as Kinase Inhibitors in Particular Ikk2 Inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-10-30 US disclosed
EP-1919907-A2 HETEROCYCLIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-05-14 EP disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
US-20050096471-A1 Process for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-05 US disclosed
EP-1473286-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2004-11-03 EP disclosed
US-4878938-A PRE- AND POSTEMERGENCE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-11-07 US disclosed
US-4764204-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-08-16 US disclosed
US-4705556-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES PFKFB3, PFKFB4, PFKFB1 PTGS2 861/4885NR1H2 3194/4885NR1H3 3202/4885
US-20180118646-A1 METHOD FOR PRODUCING AROMATIC COMPOUND HAO2, PAH, TYR PTGS2 3659/4885NR1H2 4574/4885NR1H3 4326/4885
US-10246393-B2 Method for producing aromatic compound HAO2, PAH, TYR PTGS2 3659/4885NR1H2 4574/4885NR1H3 4326/4885
US-20050096471-A1 Process for producing biaryl compound PPOX, CAT, TYR PTGS2 830/4885NR1H2 1482/4885NR1H3 1907/4885
US-20080269200-A1 Indole Derivatives and Use Thereof as Kinase Inhibitors in Particular Ikk2 Inhibitors NFKBIA, IKBKB, IDO2 PTGS2 35/4885NR1H2 700/4885NR1H3 951/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.